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Ziprasidone hydrochloride monohydrate

CAT: 0013-GTR19176537-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19176537-01Size:10 mg
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Description
Ziprasidone hydrochloride monohydrate (CP 88059) is a combined serotonin and dopamine receptor antagonist with demonstrated antipsychotic activity. It is widely used in neuroscience research for investigating schizophrenia mechanisms and has been applied in both in vitro receptor binding assays and in vivo behavioral studies.
CAS Number
138982-67-9
Product Name Alternative
Ziprasidone hydrochloride, Ziprasidone Hydrochloride, Ziprasidone hydrochloride monohydrate, Ziprasidone hydrochloride Monohydrate, serotonin, Serotonin Receptor, α2A-adrenergic receptor, α1A-adrenergic receptor, 5-HT6, 5-HT7, 5HT Receptor, 5-hydroxytryptamine Receptor, 5HTReceptor, AdrenergicReceptor, Adrenergic Receptor, 5-HT2C, 5-HT1D, 5-HT1B, 5-HT1A, 5-HT2A, 5-HT transporter, 5-HT Receptor, antipsychotic agent, Dopamine, Dopamine Receptor, DopamineReceptor, D1, D3, D2, CP88059, CP-88059, CP 88059, CP 88059 hydrochloride, norepinephrine transporter (NET), inhibit, Inhibitor, Histamine Receptor, HistamineReceptor, HEK-293, H1 receptor
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Purity
98.00% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.14 mM) ; DMSO:4.67 mg/mL (10 mM)
Smiles
O.Cl.Clc1cc2NC (=O) Cc2cc1CCN1CCN (CC1) c1nsc2ccccc12
Molecular Formula
C21H21ClN4OS·HCl·H2O
Molecular Weight
467.12
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ziprasidone hydrochloride monohydrate

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CAS Number138982-67-9
PubChem CID60853
IUPAC Name5-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one;hydrate;hydrochloride
Molecular FormulaC21H24Cl2N4O2S
Molecular Weight467.4
Topological Polar Surface Area77.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity573
SMILES
C1CN(CCN1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)C4=NSC5=CC=CC=C54.O.Cl
InChI
InChI=1S/C21H21ClN4OS.ClH.H2O/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21;;/h1-4,11,13H,5-10,12H2,(H,23,27);1H;1H2
InChIKey
ZCBZSCBNOOIHFP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ziprasidone hydrochloride monohydrate
CAS: 138982-67-9
CID: 60853
Formula: C21H24Cl2N4O2S
MW: 467.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass466.0997026
Monoisotopic Mass466.0997026
Topological Polar Surface Area77.7 Ų
Heavy Atom Count30
Formal Charge0
Complexity573
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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